SCHEMBL21837384

SCHEMBL21837384

C=CCCC(=O)NC(CCc1ccccc1Cl)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.45
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP12 P39900 1/20 0.43
MMP14 P50281 1/20 0.43
CTSG P08311 1/20 0.42
CMA1 P23946 1/20 0.42
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
HIF1A Q16665 1/20 0.40
PLAAT3 P53816 2/20 0.38
PLAAT5 Q96KN8 2/20 0.38
PLAAT2 Q9NWW9 2/20 0.38
PLAAT4 Q9UL19 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CCKBR P32239 1/20 0.38
MME P08473 1/20 0.37
C3AR1 Q16581 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21837383 1.00 FOLH1 (0.45) FOLH1MMP2MMP9MMP8MMP12
SCHEMBL21837370 0.86 ACE (0.49) CTSGCMA1SMN1; SMN2CCKBRMME
SCHEMBL21837371 0.86 ACE (0.49) CTSGCMA1SMN1; SMN2CCKBRMME
SCHEMBL21950787 0.84 FOLH1 (0.47) FOLH1MMP2MMP9MMP8MMP12
SCHEMBL21896476 0.82 CTSG (0.35) MMP2MMP9MMP8MMP12MMP14
SCHEMBL28362197 0.82 CTSG (0.35) MMP2MMP9MMP8MMP12MMP14
SCHEMBL21837600 0.82 FOLH1 (0.42) FOLH1PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL21837599 0.82 FOLH1 (0.42) FOLH1PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL21837400 0.82 FOLH1 (0.47) FOLH1CTSGCMA1PLAAT3PLAAT5
SCHEMBL21837402 0.82 FOLH1 (0.47) FOLH1CTSGCMA1PLAAT3PLAAT5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118256591-A Cyclic peptide compound having high membrane permeability and library comprising same 中外制药株式会社 2024-06-28 CN disclosed
CN-110869544-B Cyclic peptide compound having high membrane permeability and library comprising same 中外制药株式会社 2024-03-08 CN disclosed
US-20200131669-A1 CYCLIC PEPTIDE COMPOUND HAVING HIGH MEMBRANE PERMEABILITY, AND LIBRARY CONTAINING SAME CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2020-04-30 US disclosed
EP-3636807-A1 CYCLIC PEPTIDE COMPOUND HAVING HIGH MEMBRANE PERMEABILITY, AND LIBRARY CONTAINING SAME Chugai Seiyaku Kabushiki Kaisha (JP) 2020-04-15 EP disclosed
CN-110869544-A Cyclic peptide compound having high membrane permeability and library containing same 中外制药株式会社 2020-03-06 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200131669-A1 CYCLIC PEPTIDE COMPOUND HAVING HIGH MEMBRANE PERMEABILITY, AND LIBRARY CONTAINING SAME VIP, SLC7A1, TRPV1 FOLH1 1020/4885MMP2 953/4885MMP9 1418/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.